==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=20-JUL-2011 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER STRUCTURAL GENOMICS, UNKNOWN FUNCTION 09-JUN-06 2DRH . COMPND 2 MOLECULE: 361AA LONG HYPOTHETICAL D-AMINOPEPTIDASE; . SOURCE 2 ORGANISM_SCIENTIFIC: PYROCOCCUS HORIKOSHII; . AUTHOR H.MIZUTANI,N.KUNISHIMA,RIKEN STRUCTURAL GENOMICS/PROTEOMICS . 1413 8 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 41146.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 963 68.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 64 4.5 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 276 19.5 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 12 0.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 16 1.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-3), SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-2), SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-1), SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+0), SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+1), SAME NUMBER PER 100 RESIDUES . 119 8.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 163 11.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 291 20.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 16 1.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+5), SAME NUMBER PER 100 RESIDUES . 1 2 3 4 5 6 7 8 9 10 11 12 13 14 15 16 17 18 19 20 21 22 23 24 25 26 27 28 29 30 *** HISTOGRAMS OF *** . 0 0 0 6 0 0 4 0 1 7 0 0 0 0 4 0 3 1 0 3 1 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 4 0 0 0 4 0 4 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 PARALLEL BRIDGES PER LADDER . 22 12 4 0 2 0 4 0 6 4 2 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 ANTIPARALLEL BRIDGES PER LADDER . 10 0 0 0 0 4 0 0 0 0 2 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 LADDERS PER SHEET . # RESIDUE AA STRUCTURE BP1 BP2 ACC N-H-->O O-->H-N N-H-->O O-->H-N TCO KAPPA ALPHA PHI PSI X-CA Y-CA Z-CA 1 1 A M 0 0 82 0, 0.0 2,-0.3 0, 0.0 325,-0.1 0.000 360.0 360.0 360.0-130.9 62.2 13.6 40.5 2 2 A K - 0 0 11 322,-0.1 4,-0.3 1,-0.1 3,-0.2 -0.699 360.0-110.8-105.0 156.7 58.6 14.2 41.7 3 3 A A S > >S+ 0 0 0 -2,-0.3 5,-1.7 1,-0.2 3,-1.4 0.809 112.7 63.3 -51.3 -36.4 55.3 13.3 40.1 4 4 A Q G > 5S+ 0 0 69 1,-0.3 3,-3.4 2,-0.2 -1,-0.2 0.975 98.4 51.6 -53.9 -62.1 54.5 17.0 39.4 5 5 A E G 3 5S+ 0 0 109 1,-0.3 -1,-0.3 -3,-0.2 -2,-0.2 0.487 109.5 54.9 -56.0 -2.6 57.5 17.6 37.1 6 6 A L G < 5S- 0 0 20 -3,-1.4 -1,-0.3 -4,-0.3 -2,-0.2 0.334 115.1-113.8-111.9 2.3 56.2 14.5 35.2 7 7 A G T < 5 + 0 0 36 -3,-3.4 2,-0.6 1,-0.3 -3,-0.2 0.438 67.7 145.1 80.3 -2.5 52.7 15.8 34.7 8 8 A I < - 0 0 3 -5,-1.7 2,-0.5 347,-0.2 -1,-0.3 -0.597 36.3-155.1 -74.0 117.9 51.3 13.1 36.9 9 9 A K + 0 0 174 -2,-0.6 2,-0.4 -3,-0.1 3,-0.0 -0.839 15.1 179.3-100.0 126.4 48.3 14.6 38.8 10 10 A I - 0 0 8 -2,-0.5 3,-0.1 3,-0.1 307,-0.1 -0.988 54.4 -16.0-128.2 121.6 47.3 13.1 42.1 11 11 A G S S- 0 0 40 -2,-0.4 299,-0.1 1,-0.1 298,-0.0 -0.255 74.3 -95.4 82.5-172.7 44.3 14.6 44.0 12 12 A V S S+ 0 0 100 2,-0.1 2,-0.2 -2,-0.0 -1,-0.1 0.419 89.3 93.6-123.8 -7.6 42.7 17.9 43.5 13 13 A F S S- 0 0 54 -3,-0.1 -3,-0.1 296,-0.1 179,-0.1 -0.621 77.7-113.9 -89.1 150.7 44.4 20.1 46.1 14 14 A K - 0 0 110 177,-0.5 177,-3.1 -2,-0.2 -2,-0.1 -0.581 31.2-119.4 -83.1 145.1 47.5 22.2 45.1 15 15 A P - 0 0 40 0, 0.0 175,-0.3 0, 0.0 -1,-0.1 -0.240 30.6 -97.9 -76.5 170.3 50.8 21.2 46.7 16 16 A G - 0 0 11 173,-0.2 173,-0.1 185,-0.1 175,-0.1 -0.250 46.3 -87.2 -79.7 176.3 52.9 23.5 48.8 17 17 A K S S+ 0 0 215 1,-0.2 -1,-0.1 6,-0.1 6,-0.0 0.889 129.8 23.8 -51.1 -49.4 55.9 25.6 47.6 18 18 A R S S- 0 0 112 2,-0.2 -1,-0.2 170,-0.0 3,-0.1 0.627 98.2-134.0 -92.9 -15.1 58.4 22.8 48.0 19 19 A N + 0 0 11 1,-0.3 2,-0.3 169,-0.1 168,-0.1 0.950 69.9 111.4 57.1 49.3 55.9 20.0 47.9 20 20 A K S > S- 0 0 21 168,-0.2 3,-2.3 166,-0.0 -1,-0.3 -0.953 87.9-101.7-145.3 159.7 57.5 18.5 50.9 21 21 A I G > S+ 0 0 0 182,-0.4 3,-1.7 -2,-0.3 6,-0.2 0.779 116.2 70.6 -55.6 -27.2 56.5 18.0 54.6 22 22 A T G 3 S+ 0 0 8 1,-0.3 -1,-0.3 141,-0.3 4,-0.3 0.422 70.5 87.3 -72.4 1.8 58.7 21.0 55.4 23 23 A D G < S+ 0 0 26 -3,-2.3 2,-1.1 2,-0.1 -1,-0.3 0.657 70.2 87.2 -72.1 -13.7 56.2 23.2 53.7 24 24 A V S X S- 0 0 0 -3,-1.7 3,-2.3 -4,-0.2 -1,-0.1 -0.789 102.8-114.6 -84.7 103.0 54.7 23.1 57.2 25 25 A K T 3 S+ 0 0 112 -2,-1.1 -2,-0.1 1,-0.3 3,-0.1 -0.106 95.9 20.4 -45.3 127.4 56.7 26.0 58.6 26 26 A G T 3 S+ 0 0 15 1,-0.4 -1,-0.3 -4,-0.3 2,-0.1 -0.035 91.1 120.4 102.9 -31.4 59.2 24.9 61.3 27 27 A V < - 0 0 0 -3,-2.3 -1,-0.4 -6,-0.2 2,-0.3 -0.448 42.0-173.1 -68.9 138.7 59.3 21.2 60.3 28 28 A K E -A 56 0A 45 28,-1.7 28,-2.6 30,-0.2 2,-0.4 -0.983 13.6-157.2-137.5 148.1 62.8 20.0 59.4 29 29 A V E -AB 55 162A 1 133,-2.5 133,-1.7 -2,-0.3 2,-0.3 -0.988 10.3-178.8-129.0 132.2 64.2 16.8 57.9 30 30 A G E -A 54 0A 3 24,-2.1 24,-2.7 -2,-0.4 2,-0.3 -0.967 7.3-159.0-130.7 147.1 67.8 15.4 58.2 31 31 A H E -A 53 0A 18 -2,-0.3 2,-0.4 22,-0.2 22,-0.2 -0.882 15.1-168.8-126.3 157.4 69.5 12.3 56.8 32 32 A V E -A 52 0A 7 20,-1.7 20,-2.2 -2,-0.3 2,-0.4 -0.956 20.2-160.0-142.1 116.3 72.5 10.1 57.4 33 33 A T E -A 51 0A 54 -2,-0.4 2,-0.6 18,-0.2 18,-0.2 -0.886 5.4-164.2-107.7 131.9 73.2 7.6 54.6 34 34 A L E +A 50 0A 32 16,-2.6 16,-1.9 -2,-0.4 2,-0.4 -0.908 19.9 156.7-121.4 105.5 75.3 4.5 55.1 35 35 A I E +A 49 0A 70 -2,-0.6 2,-0.3 14,-0.2 14,-0.2 -0.992 12.4 138.5-129.8 124.8 76.5 2.6 52.0 36 36 A K E +A 48 0A 113 12,-2.0 12,-3.2 -2,-0.4 -2,-0.0 -0.936 42.6 12.5-166.1 141.0 79.6 0.4 52.0 37 37 A G - 0 0 35 -2,-0.3 2,-0.3 10,-0.2 -1,-0.1 -0.060 55.0-139.8 82.7 173.6 80.7 -2.9 50.6 38 38 A K + 0 0 173 2,-0.1 294,-0.1 9,-0.1 2,-0.1 -0.976 48.5 28.1-165.6 163.9 79.3 -5.2 47.9 39 39 A G S S+ 0 0 14 292,-0.5 294,-1.6 -2,-0.3 295,-0.5 -0.358 92.3 28.5 82.0-159.3 78.7 -8.8 47.1 40 40 A K S S- 0 0 162 293,-0.2 2,-0.4 292,-0.2 -2,-0.1 0.099 85.1-103.7 -36.9 142.9 78.1 -11.8 49.4 41 41 A L - 0 0 16 291,-0.1 -1,-0.1 1,-0.1 101,-0.0 -0.621 31.5-172.8 -78.6 127.8 76.5 -11.1 52.7 42 42 A I B >> -L 46 0B 83 4,-3.4 3,-3.0 -2,-0.4 4,-2.2 -0.848 29.3-131.0-120.5 88.5 79.0 -11.2 55.6 43 43 A P T 34 S+ 0 0 80 0, 0.0 101,-0.0 0, 0.0 1147,-0.0 -0.145 91.0 16.5 -44.5 116.3 76.7 -10.9 58.7 44 44 A G T 34 S+ 0 0 47 99,-0.1 -3,-0.0 0, 0.0 99,-0.0 0.143 128.6 54.4 102.8 -17.2 78.0 -8.2 61.0 45 45 A K T <4 S+ 0 0 109 -3,-3.0 3,-0.1 1,-0.3 98,-0.1 0.767 92.1 177.3-113.8 -47.7 80.2 -6.7 58.3 46 46 A G B < -L 42 0B 1 -4,-2.2 -4,-3.4 1,-0.2 -1,-0.3 -0.971 62.0-103.0 157.4-169.3 78.2 -5.9 55.2 47 47 A P - 0 0 3 0, 0.0 96,-1.4 0, 0.0 2,-0.5 0.466 63.6-154.1 -59.9 148.6 77.2 -5.0 52.5 48 48 A V E +A 36 0A 8 -12,-3.2 -12,-2.0 94,-0.2 2,-0.1 -0.908 32.4 155.6-110.0 123.6 75.7 -2.0 54.4 49 49 A R E +A 35 0A 8 -2,-0.5 126,-0.2 -14,-0.2 2,-0.2 -0.635 42.2 96.3-142.5 74.2 72.8 -0.1 52.9 50 50 A T E +A 34 0A 0 -16,-1.9 -16,-2.6 124,-0.2 2,-0.3 -0.711 35.8 158.5-144.5-165.6 70.9 1.5 55.8 51 51 A G E -A 33 0A 0 -18,-0.2 49,-0.4 -2,-0.2 2,-0.3 -0.994 32.6 -88.5 167.2-168.1 70.7 4.9 57.6 52 52 A V E -A 32 0A 0 -20,-2.2 -20,-1.7 -2,-0.3 2,-0.4 -0.997 20.9-165.7-140.8 140.9 68.8 7.2 59.8 53 53 A T E -AC 31 98A 0 45,-2.1 45,-2.4 -2,-0.3 2,-0.4 -0.996 8.6-160.2-129.8 130.6 66.2 10.0 59.1 54 54 A A E -AC 30 97A 0 -24,-2.7 -24,-2.1 -2,-0.4 2,-0.5 -0.917 3.9-166.5-114.6 135.6 65.2 12.6 61.7 55 55 A I E -AC 29 96A 0 41,-2.9 41,-3.7 -2,-0.4 -26,-0.2 -0.982 6.7-160.0-122.2 120.6 62.0 14.7 61.6 56 56 A L E -A 28 0A 12 -28,-2.6 -28,-1.7 -2,-0.5 3,-0.0 -0.880 13.0-148.8-101.7 124.9 61.7 17.7 63.9 57 57 A P S S- 0 0 0 0, 0.0 2,-0.2 0, 0.0 -1,-0.1 0.886 80.3 -18.9 -57.2 -41.1 58.2 19.0 64.6 58 58 A H S S- 0 0 3 2,-0.2 -30,-0.2 -31,-0.1 4,-0.1 -0.799 75.5 -92.2-149.5-168.8 59.6 22.5 65.0 59 59 A E S S+ 0 0 121 -2,-0.2 3,-0.1 2,-0.1 -33,-0.0 0.507 94.2 63.3 -97.7 -4.5 62.9 24.3 65.6 60 60 A G S S- 0 0 37 1,-0.1 2,-0.9 5,-0.1 -2,-0.2 0.052 107.0 -44.1 -97.9-150.5 63.0 24.7 69.3 61 61 A N > - 0 0 50 1,-0.2 4,-2.2 2,-0.0 -1,-0.1 -0.732 48.0-166.4 -84.9 107.4 63.1 22.3 72.3 62 62 A I T 4 S+ 0 0 11 -2,-0.9 32,-0.2 1,-0.2 -1,-0.2 0.806 84.8 52.5 -64.6 -31.4 60.6 19.6 71.4 63 63 A Y T 4 S+ 0 0 3 1,-0.2 3,-0.3 3,-0.1 -1,-0.2 0.914 115.9 37.1 -71.8 -44.9 60.6 18.2 75.0 64 64 A K T 4 S+ 0 0 52 1,-0.3 224,-2.5 223,-0.1 2,-0.5 0.791 127.6 39.6 -77.8 -28.6 59.9 21.5 76.8 65 65 A E E < S-M 287 0C 62 -4,-2.2 -1,-0.3 222,-0.2 222,-0.2 -0.822 85.7-172.1-124.6 90.8 57.6 22.6 74.0 66 66 A K E -M 286 0C 12 220,-3.1 220,-3.3 -2,-0.5 2,-0.4 -0.307 14.3-137.4 -79.6 160.4 55.6 19.6 72.9 67 67 A V E -MN 285 92C 0 25,-1.8 25,-2.0 218,-0.2 218,-0.2 -0.918 25.7-108.3-118.3 147.1 53.2 19.3 69.9 68 68 A L E + N 0 91C 13 216,-0.9 213,-2.1 213,-0.4 2,-0.3 -0.499 50.2 175.3 -70.7 142.8 49.8 17.6 70.0 69 69 A A E -M 280 0C 1 21,-3.2 2,-0.3 17,-0.2 211,-0.3 -0.972 23.3-167.6-150.8 164.7 49.9 14.3 68.1 70 70 A G E -M 279 0C 0 209,-3.8 209,-2.5 181,-0.3 2,-0.3 -0.893 7.9-167.4-143.7 171.1 48.0 11.2 67.0 71 71 A A E -M 278 0C 5 -2,-0.3 2,-0.4 207,-0.2 207,-0.2 -0.989 9.2-156.3-163.3 155.1 48.8 7.8 65.4 72 72 A F E -M 277 0C 19 205,-2.4 205,-2.4 -2,-0.3 2,-0.8 -0.990 9.9-150.5-140.3 128.8 47.3 4.8 63.8 73 73 A V E +M 276 0C 17 -2,-0.4 3,-0.2 203,-0.2 203,-0.2 -0.877 16.1 175.7 -98.2 110.1 48.6 1.2 63.4 74 74 A M E S+ 0 0 3 201,-1.9 2,-0.4 -2,-0.8 -1,-0.2 0.918 81.8 5.5 -76.9 -47.9 47.1 -0.2 60.2 75 75 A N E -M 275 0C 0 200,-1.8 200,-1.1 -3,-0.2 -1,-0.3 -0.944 69.0-152.2-140.2 115.5 49.2 -3.4 60.6 76 76 A G E +M 274 0C 0 -2,-0.4 2,-2.4 -3,-0.2 1078,-0.3 0.032 58.4 119.9 -76.7 26.2 51.3 -4.0 63.7 77 77 A Y + 0 0 43 196,-0.5 2,-0.3 -2,-0.3 197,-0.3 -0.431 64.4 97.0 -85.4 65.0 54.0 -6.2 62.2 78 78 A S S S- 0 0 1 -2,-2.4 1073,-0.3 195,-0.1 58,-0.1 -0.956 72.9-137.6-150.5 159.0 56.3 -3.4 63.3 79 79 A K + 0 0 1 -2,-0.3 2,-0.1 1071,-0.1 57,-0.1 -0.491 36.0 168.5-121.3 60.2 58.5 -2.5 66.3 80 80 A P - 0 0 6 0, 0.0 1068,-0.6 0, 0.0 2,-0.5 -0.439 22.8-147.3 -75.8 150.7 57.8 1.2 67.0 81 81 A V B S+DE 1331147A 1 52,-3.6 52,-2.5 1066,-0.1 1066,-0.1 -0.972 74.2 22.9-118.4 127.5 59.1 2.9 70.1 82 82 A G S > S+ 0 0 3 1064,-0.6 4,-1.3 -2,-0.5 3,-0.2 0.326 78.3 113.1 106.0 -7.7 57.1 5.7 71.8 83 83 A L H > + 0 0 2 1,-0.2 4,-2.4 2,-0.2 5,-0.2 0.835 67.9 63.8 -69.5 -33.4 53.5 5.2 70.6 84 84 A I H > S+ 0 0 10 1062,-0.3 4,-1.9 1,-0.2 -1,-0.2 0.918 109.6 38.5 -59.1 -43.4 51.9 4.2 74.0 85 85 A Q H >>S+ 0 0 2 1059,-0.3 4,-2.9 2,-0.2 5,-0.6 0.836 110.1 61.2 -76.3 -30.4 52.6 7.6 75.6 86 86 A L H X5S+ 0 0 2 -4,-1.3 4,-1.9 1,-0.2 5,-0.3 0.957 111.1 40.7 -57.8 -47.0 51.8 9.5 72.4 87 87 A W H <5S+ 0 0 77 -4,-2.4 -2,-0.2 2,-0.2 -1,-0.2 0.878 117.1 48.0 -67.5 -40.8 48.3 8.0 72.6 88 88 A E H <5S+ 0 0 19 -4,-1.9 -2,-0.2 1054,-0.2 -1,-0.2 0.927 127.5 23.0 -68.4 -47.4 47.9 8.5 76.3 89 89 A L H <5S- 0 0 12 -4,-2.9 -2,-0.2 1053,-0.2 -3,-0.2 0.618 96.9-130.6 -95.5 -16.2 49.1 12.1 76.6 90 90 A G << + 0 0 2 -4,-1.9 -21,-3.2 -5,-0.6 2,-0.3 0.704 68.3 106.8 73.9 21.7 48.4 13.1 73.0 91 91 A T E -N 68 0C 10 -6,-0.5 2,-0.4 -23,-0.3 -1,-0.2 -0.876 59.9-144.0-135.6 164.9 51.8 14.6 72.5 92 92 A I E +N 67 0C 5 -25,-2.0 -25,-1.8 -2,-0.3 4,-0.1 -0.995 18.7 172.7-123.5 128.7 55.3 14.2 70.8 93 93 A E + 0 0 4 -2,-0.4 -28,-0.1 37,-0.4 -1,-0.1 0.119 59.3 49.5-126.6 20.4 58.2 15.5 72.9 94 94 A T S S- 0 0 1 -32,-0.2 17,-0.0 36,-0.1 -33,-0.0 -0.962 92.8 -86.1-151.5 160.5 61.2 14.4 70.9 95 95 A P - 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